N-(3-methylbutyl)-4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzamide
Chemical Structure Depiction of
N-(3-methylbutyl)-4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzamide
N-(3-methylbutyl)-4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzamide
Compound characteristics
| Compound ID: | F616-0705 |
| Compound Name: | N-(3-methylbutyl)-4-{3-[(4-methylphenyl)sulfanyl]-6-oxopyridazin-1(6H)-yl}benzamide |
| Molecular Weight: | 407.53 |
| Molecular Formula: | C23 H25 N3 O2 S |
| Smiles: | CC(C)CCNC(c1ccc(cc1)N1C(C=CC(=N1)Sc1ccc(C)cc1)=O)=O |
| Stereo: | ACHIRAL |
| logP: | 4.7384 |
| logD: | 4.7384 |
| logSw: | -4.3664 |
| Hydrogen bond acceptors count: | 6 |
| Hydrogen bond donors count: | 1 |
| Polar surface area: | 52.074 |
| InChI Key: | YSJQVCCFDXZHRG-UHFFFAOYSA-N |